Crystallography Open Database

Information card for entry 4519359

4519358 << 4519359 >> 4519360

Preview

Coordinates	4519359.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32.25 H30.5 Cl0.5 N2 O3
Calculated formula	C32.25 H30.5 Cl0.5 N2 O3
Title of publication	Camphorsulfonic Acid-Mediated One-Pot Tandem Consecutive via the Ugi Four-Component Reaction for the Synthesis of Functionalized Indole and 2-Quinolone Derivatives by Switching Solvents.
Authors of publication	Murugan, Sivan Perumal; Zhong, Hong-Jie; Wu, Chih-Yu; Pan, Hao-Wei; Chen, Chinpiao; Lee, Gene-Hsian
Journal of publication	ACS omega
Year of publication	2022
Journal volume	7
Journal issue	7
Pages of publication	5713 - 5729
a	14.8518 ± 0.0004 Å
b	15.7023 ± 0.0005 Å
c	25.8545 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	6029.5 ± 0.3 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0823
Residual factor for significantly intense reflections	0.0664
Weighted residual factors for significantly intense reflections	0.186
Weighted residual factors for all reflections included in the refinement	0.1995
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
273266 (current)	2022-03-03	cif/ Adding structures of 4519359 via cif-deposit CGI script.	4519359.cif